2-(4-chlorophenyl)-N-[4-[(6-methylpyridazin-3-yl)amino]phenyl]acetamide

C19H17ClN4O — CID 56919650

IUPAC2-(4-chlorophenyl)-N-[4-[(6-methylpyridazin-3-yl)amino]phenyl]acetamide
SMILESCc1ccc(Nc2ccc(NC(=O)Cc3ccc(Cl)cc3)cc2)nn1
InChIInChI=1S/C19H17ClN4O/c1-13-2-11-18(24-23-13)21-16-7-9-17(10-8-16)22-19(25)12-14-3-5-15(20)6-4-14/h2-11H,12H2,1H3,(H,21,24)(H,22,25)
InChIKeyNCGQCQMAWYTOSV-UHFFFAOYSA-N
MW352.83 g/mol
LogP4.36
Rot. Bonds5

About 2-(4-chlorophenyl)-N-[4-[(6-methylpyridazin-3-yl)amino]phenyl]acetamide

2-(4-chlorophenyl)-N-[4-[(6-methylpyridazin-3-yl)amino]phenyl]acetamide (PubChem CID 56919650) has the molecular formula C19H17ClN4O and a molecular weight of 352.83 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-N-[4-[(6-methylpyridazin-3-yl)amino]phenyl]acetamide.

Molecular Properties

Compound Name2-(4-chlorophenyl)-N-[4-[(6-methylpyridazin-3-yl)amino]phenyl]acetamide
PubChem CID56919650
Molecular FormulaC19H17ClN4O
Molecular Weight352.83 g/mol
Exact Mass352.11
IUPAC Name2-(4-chlorophenyl)-N-[4-[(6-methylpyridazin-3-yl)amino]phenyl]acetamide
SMILESCc1ccc(Nc2ccc(NC(=O)Cc3ccc(Cl)cc3)cc2)nn1
InChIInChI=1S/C19H17ClN4O/c1-13-2-11-18(24-23-13)21-16-7-9-17(10-8-16)22-19(25)12-14-3-5-15(20)6-4-14/h2-11H,12H2,1H3,(H,21,24)(H,22,25)
InChIKeyNCGQCQMAWYTOSV-UHFFFAOYSA-N
XLogP4.36
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.83
LogP ≤ 54.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[6-(4-chloroanilino)pyridazin-3-yl]-2-(3-methylphenyl)acetamide
CID 113047565
N-[6-(4-acetamidoanilino)pyridazin-3-yl]-2-(4-fluorophenyl)acetamide
CID 113049292
N-[6-(3,4-difluoroanilino)pyridazin-3-yl]-2-(4-methylphenyl)acetamide
CID 113051664
N-[4-(4-chloroanilino)phenyl]-2-phenylacetamide
CID 112987026
N-[6-(4-chloroanilino)pyridazin-3-yl]-2-(2-fluorophenyl)acetamide
CID 113047562
2-(4-chlorophenyl)-N-[4-[[4-(dimethylamino)-6-methylpyrimidin-2-yl]amino]phenyl]acetamide
CID 122287191
2-(4-chlorophenyl)-N-[6-(propan-2-ylamino)pyridazin-3-yl]acetamide
CID 113037948
N-(4-chlorophenyl)-2-(4-fluorophenyl)acetamide
CID 7027780
methyl 4-[[6-[[2-(4-methylphenyl)acetyl]amino]pyridazin-3-yl]amino]benzoate
CID 113049499
N-[6-(4-chloroanilino)pyridazin-3-yl]-2-thiophen-2-ylacetamide
CID 113047543
6-(4-acetamidoanilino)-N-(4-chlorophenyl)pyridazine-3-carboxamide
CID 109128783
N-[2-(4-acetamidoanilino)-2-oxoethyl]-2-(4-chlorophenyl)acetamide
CID 112999737

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-N-[4-[(6-methylpyridazin-3-yl)amino]phenyl]acetamide?
The IUPAC name of 2-(4-chlorophenyl)-N-[4-[(6-methylpyridazin-3-yl)amino]phenyl]acetamide (CID 56919650) is 2-(4-chlorophenyl)-N-[4-[(6-methylpyridazin-3-yl)amino]phenyl]acetamide.
What is the SMILES notation for 2-(4-chlorophenyl)-N-[4-[(6-methylpyridazin-3-yl)amino]phenyl]acetamide?
The canonical SMILES for 2-(4-chlorophenyl)-N-[4-[(6-methylpyridazin-3-yl)amino]phenyl]acetamide is Cc1ccc(Nc2ccc(NC(=O)Cc3ccc(Cl)cc3)cc2)nn1.
What is the InChIKey of 2-(4-chlorophenyl)-N-[4-[(6-methylpyridazin-3-yl)amino]phenyl]acetamide?
The InChIKey is NCGQCQMAWYTOSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17ClN4O/c1-13-2-11-18(24-23-13)21-16-7-9-17(10-8-16)22-19(25)12-14-3-5-15(20)6-4-14/h2-11H,12H2,1H3,(H,21,24)(H,22,25).
What are the key properties of 2-(4-chlorophenyl)-N-[4-[(6-methylpyridazin-3-yl)amino]phenyl]acetamide?
2-(4-chlorophenyl)-N-[4-[(6-methylpyridazin-3-yl)amino]phenyl]acetamide has a molecular weight of 352.83 g/mol, XLogP of 4.36, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-N-[4-[(6-methylpyridazin-3-yl)amino]phenyl]acetamide is sourced from PubChem (CID 56919650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).